4-[3-(trifluoromethyl)phenyl]carbonyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[3-(trifluoromethyl)phenyl]carbonyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[3-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[3-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[3-(trifluoromethyl)benzoyl]-1H-pyrrole-2-carboxylic acid Formula: C13H8F3NO3 MolecularWeight: 283.20273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C13H8F3NO3/c14-13(15,16)9-3-1-2-7(4-9)11(18)8-5-10(12(19)20)17-6-8/h1-6,17H,(H,19,20)